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(E)-1-(Pentafluorophenyl)-2-nitroprop-1-ene
SpectraBase Compound ID 4FiYgYzG7Tb
InChI InChI=1S/C9H4F5NO2/c1-3(15(16)17)2-4-5(10)7(12)9(14)8(13)6(4)11/h2H,1H3/b3-2+
InChIKey JBISSXUPOGUBBG-NSCUHMNNSA-N
Mol Weight 253.13 g/mol
Molecular Formula C9H4F5NO2
Exact Mass 253.016219 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nVwLTAYq00
Name (E)-1-(Pentafluorophenyl)-2-nitroprop-1-ene
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 253.016219186 u
Formula C9H4F5NO2
InChI InChI=1S/C9H4F5NO2/c1-3(15(16)17)2-4-5(10)7(12)9(14)8(13)6(4)11/h2H,1H3/b3-2+
InChIKey JBISSXUPOGUBBG-NSCUHMNNSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 253.128 g/mol
Nominal Mass 253 u
Quality 993
Retention Index 1269
SMILES C1(=C(C(=C(C(=C1F)F)F)F)F)\C=C/([N+](=O)[O-])C
SPLASH splash10-053i-4910000000-e294d4143aab65436657
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1,2,3,4,5-pentafluoro-6-((1E)-2-nitroprop-1-en-1-yl)benzene
Technique GC/MS
Wiley ID DD2024_004503